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Impact of Structural Functionalization, Pore Size, and Presence of Extra-Framework Ions on the Capture of Gaseous I(2) by MOF Materials
A computational approach is used on MOF materials to predict the structures showing the best performances for I(2) adsorption as a function of the functionalization, the pore size, the presence of the compensating ions, and the flexibility on which to base future improvements in selected materials i...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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MDPI
2021
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8467223/ https://www.ncbi.nlm.nih.gov/pubmed/34578560 http://dx.doi.org/10.3390/nano11092245 |